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TMACC: Interpretable Correlation Descriptors for Quantitative Structure-Activity Relationships.

James L. MelvilleJonathan D. Hirst
Published in: J. Chem. Inf. Model. (2007)
Keyphrases
  • quantitative structure activity
  • drug design
  • drug discovery
  • data sets
  • machine learning
  • bayesian networks
  • early stage